2-(2-ethanoylphenoxy)ethyl 2-(diethylamino)-5-nitro-benzoate

Systemtic Name: 2-(2-ethanoylphenoxy)ethyl 2-(diethylamino)-5-nitro-benzoate Openeye Name: 2-(2-acetylphenoxy)ethyl 2-(diethylamino)-5-nitro-benzoate CAS Name: 2-(diethylamino)-5-nitrobenzoic acid 2-(2-acetylphenoxy)ethyl ester IUPAC Name: 2-(2-acetylphenoxy)ethyl 2-(diethylamino)-5-nitrobenzoate Traditional Name: 2-(diethylamino)-5-nitro-benzoic acid 2-(2-acetylphenoxy)ethyl ester Formula: C21H24N2O6 MolecularWeight: 400.42506

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=C(C=C(C=C1)[N+](=O)[O-])C(=O)OCCOC2=CC=CC=C2C(=O)C

Isomeric SMILES

CCN(CC)C1=C(C=C(C=C1)[N+](=O)[O-])C(=O)OCCOC2=CC=CC=C2C(=O)C

InChI

InChI=1S/C21H24N2O6/c1-4-22(5-2)19-11-10-16(23(26)27)14-18(19)21(25)29-13-12-28-20-9-7-6-8-17(20)15(3)24/h6-11,14H,4-5,12-13H2,1-3H3